BindingDB logo
myBDB logout

BDBM50033664 CHEMBL7068::{[4-(2-Amino-6-oxo-1,6-dihydro-purin-9-yl)-butyl]-hydroxy-phosphinoylmethyl}-phosphonic acid

SMILES: Nc1nc2n(CCCCP(O)(=O)CP(O)(O)=O)cnc2c(=O)[nH]1

InChI Key: InChIKey=RVYGISYXHVZBBV-UHFFFAOYNA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50033664   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033664
PNG
(CHEMBL7068 | {[4-(2-Amino-6-oxo-1,6-dihydro-purin-...)
Show SMILES Nc1nc2n(CCCCP(O)(=O)CP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1/C10H17N5O6P2/c11-10-13-8-7(9(16)14-10)12-5-15(8)3-1-2-4-22(17,18)6-23(19,20)21/h5H,1-4,6H2,(H,17,18)(H2,19,20,21)(H3,11,13,14,16)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
100n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of zinc chloride


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Homo sapiens (Human))
BDBM50033664
PNG
(CHEMBL7068 | {[4-(2-Amino-6-oxo-1,6-dihydro-purin-...)
Show SMILES Nc1nc2n(CCCCP(O)(=O)CP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1/C10H17N5O6P2/c11-10-13-8-7(9(16)14-10)12-5-15(8)3-1-2-4-22(17,18)6-23(19,20)21/h5H,1-4,6H2,(H,17,18)(H2,19,20,21)(H3,11,13,14,16)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.40E+3n/an/an/an/an/an/an/an/a



Burroughs Wellcome Co.

Curated by ChEMBL


Assay Description
Inhibition of human erythrocyte purine nucleoside phosphorylase (PNPase) in the presence of ethylenediaminetetraacetic acid (Na2 EDTA)


J Med Chem 38: 1005-14 (1995)


Article DOI: 10.1021/jm00006a020
BindingDB Entry DOI: 10.7270/Q2FF3RDR
More data for this
Ligand-Target Pair